File: modification_sgroup.mrv

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<?xml version="1.0" encoding="UTF-8"?>
<cml xmlns="http://www.chemaxon.com" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://www.chemaxon.com/marvin/schema/mrvSchema_20_20_0.xsd" version="ChemAxon file format v20.20.0, generated by v21.18.0">
    <MDocument>
        <MChemicalStruct>
            <molecule title="51429-74-4" molID="m1">
                <propertyList>
                    <property dictRef="type" title="type">
                        <scalar>CAS#</scalar>
                    </property>
                </propertyList>
                <atomArray atomID="a1 a2 a3 a4 a5 a6 a7 a8 a9 a10" elementType="P O O O O O Mo O O O" residueType="UNK UNK UNK UNK UNK UNK UNK UNK UNK UNK" residueId="r0 r0 r0 r0 r0 r0 r0 r0 r0 r1" residueAtomName="0 0 0 0 0 0 0 0 0 0" sgroupRef="0 0 0 0 0 sg1 sg1 sg1 sg1 sg2" x2="21.9795 21.8333 23.3803 20.5366 20.9990 15.7410 15.3425 15.6882 13.8549 22.2284" y2="-8.5811 -7.0480 -9.2209 -9.1191 -9.7686 -7.9180 -9.4055 -10.6971 -9.0069 -13.2629"></atomArray>
                <bondArray>
                    <bond id="b1" atomRefs2="a1 a2" order="1"></bond>
                    <bond id="b2" atomRefs2="a1 a3" order="2"></bond>
                    <bond id="b3" atomRefs2="a1 a4" order="1"></bond>
                    <bond id="b4" atomRefs2="a1 a5" order="1"></bond>
                    <bond id="b5" atomRefs2="a7 a6" order="2"></bond>
                    <bond id="b6" atomRefs2="a7 a8" order="2"></bond>
                    <bond id="b7" atomRefs2="a7 a9" order="2"></bond>
                </bondArray>
                <molecule id="sg1" role="MultipleSgroup" title="12" molID="m2" atomRefs="a6 a7 a8 a9">
                    <MBracket type="SQUARE" orientation="DOUBLE">
                        <MPoint x="12.7910" y="-6.9238"></MPoint>
                        <MPoint x="16.7528" y="-6.9238"></MPoint>
                        <MPoint x="16.7528" y="-11.6628"></MPoint>
                        <MPoint x="12.7910" y="-11.6628"></MPoint>
                    </MBracket>
                </molecule>
                <molecule id="sg2" role="ModificationSgroup" title="mod" molID="m3" atomRefs="a10" correspondence="" bondList="" connect="ht">
                    <MBracket type="SQUARE" orientation="DOUBLE">
                        <MPoint x="21.1784" y="-12.2521"></MPoint>
                        <MPoint x="23.9365" y="-12.2521"></MPoint>
                        <MPoint x="23.9365" y="-14.3207"></MPoint>
                        <MPoint x="21.1784" y="-14.3207"></MPoint>
                    </MBracket>
                </molecule>
            </molecule>
        </MChemicalStruct>
    </MDocument>
</cml>